(2R)-N-[(2S,3R,4E,8E,10E)-9-methyl-3-oxidanyl-1-[tris(oxidanyl)-$l^{4}-sulfanyl]oxy-octadeca-4,8,10-trien-2-yl]-2-oxidanyl-octadecanamide

Systemtic Name: (2R)-N-[(2S,3R,4E,8E,10E)-9-methyl-3-oxidanyl-1-[tris(oxidanyl)-$l^{4}-sulfanyl]oxy-octadeca-4,8,10-trien-2-yl]-2-oxidanyl-octadecanamide Openeye Name: (2R)-2-hydroxy-N-[(1S,2R,3E,7E,9E)-2-hydroxy-8-methyl-1-[(trihydroxy-$l^{4}-sulfanyl)oxymethyl]heptadeca-3,7,9-trienyl]octadecanamide CAS Name: (2R)-2-hydroxy-N-[(2S,3R,4E,8E,10E)-3-hydroxy-9-methyl-1-(trihydroxy-$l^{4}-sulfanyl)oxyoctadeca-4,8,10-trien-2-yl]octadecanamide IUPAC Name: (2R)-2-hydroxy-N-[(2S,3R,4E,8E,10E)-3-hydroxy-9-methyl-1-(trihydroxy-$l^{4}-sulfanyl)oxyoctadeca-4,8,10-trien-2-yl]octadecanamide Traditional Name: (2R)-2-hydroxy-N-[(1S,2R,3E,7E,9E)-2-hydroxy-8-methyl-1-(trihydroxysulfuranyloxymethyl)heptadeca-3,7,9-trienyl]stearamide Formula: C37H71NO7S MolecularWeight: 674.02714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)NC(COS(O)(O)O)C(C=CCCC=C(C)C=CCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](COS(O)(O)O)[C@@H](/C=C/CC/C=C(\C)/C=C/CCCCCCC)O)O

InChI

InChI=1S/C37H71NO7S/c1-4-6-8-10-12-13-14-15-16-17-18-20-22-26-31-36(40)37(41)38-34(32-45-46(42,43)44)35(39)30-27-23-25-29-33(3)28-24-21-19-11-9-7-5-2/h24,27-30,34-36,39-40,42-44H,4-23,25-26,31-32H2,1-3H3,(H,38,41)/b28-24+,30-27+,33-29+/t34-,35+,36+/m0/s1